ATOM 104
1 C1y C 39.1300 -14.0700
2 C1y C 37.9400 -14.7700
3 C1y C 40.3200 -14.7700
4 O2a O 39.1300 -12.6700
5 C1y C 37.9400 -16.1000
6 O2a O 36.7500 -14.0700
7 O2x O 40.3200 -16.1000
8 C1b C 41.5100 -14.0700
9 C1y C 39.1300 -11.3400
10 C1y C 39.1300 -16.8000
11 N1b N 36.7500 -16.8000
12 C1c C 35.5600 -14.7000
13 C1y C 37.9400 -10.6400
14 O2x O 40.3200 -10.6400
15 O1a O 39.1300 -18.5500
16 C7a C 34.3700 -14.0700
17 C1a C 35.5600 -16.1000
18 C1y C 37.9400 -9.2400
19 N1b N 36.7500 -11.3400
20 C1y C 40.3200 -9.2400
21 Z * 39.1300 -20.7200
22 O6a O 34.3700 -12.6700
23 C1y C 39.1300 -8.6100
24 O1a O 36.7500 -8.5400
25 C5a C 35.5600 -10.6400
26 C1b C 41.5100 -8.6100
27 O1a O 39.1300 -7.2100
28 C1a C 35.5600 -9.2400
29 O5a O 34.3700 -11.2700
30 Z * 39.1300 -5.1100
31 C5a C 36.4000 -18.1300
32 O5a O 37.3800 -19.1800
33 C1a C 35.0700 -18.5500
34 O7a O 32.9700 -14.6300
35 P1b P 31.5700 -14.6300
36 O1c O 31.5700 -16.0300
37 O2b O 30.1700 -14.6300
38 O1a O 41.8600 -7.2100
39 O1a O 41.8600 -12.7400
40 C1y C 28.9800 -15.3300
41 O2x O 27.7900 -14.6300
42 C1y C 26.5300 -15.3300
43 C1y C 26.5300 -16.7300
44 C1y C 27.7900 -17.4300
45 C1y C 28.9800 -16.7300
46 N1b N 30.1700 -17.4300
47 C5a C 30.1700 -18.8300
48 O5a O 28.9800 -19.5300
49 C1a C 31.3600 -19.5300
50 O1a O 27.7900 -18.8300
51 O2a O 25.3400 -17.4300
52 C1b C 25.3400 -14.6300
53 O1a O 24.9900 -13.2300
54 C1y C 24.0800 -18.1300
55 O2x O 22.8900 -17.4300
56 C1y C 21.6300 -18.1300
57 C1y C 21.6300 -19.5300
58 C1y C 22.8900 -20.2300
59 C1y C 24.0800 -19.5300
60 N1b N 25.2700 -20.2300
61 O1a O 22.8900 -21.6300
62 O2b O 20.4400 -20.2300
63 C1b C 20.4400 -17.4300
64 C5a C 25.2700 -21.6300
65 O5a O 24.0800 -22.3300
66 C1a C 26.4600 -22.3300
67 O1a O 20.0900 -16.0300
68 P1b P 19.0400 -20.2300
69 O1c O 19.0400 -21.6300
70 O1c O 19.0400 -18.8300
71 O2b O 17.6400 -20.2300
72 O1c O 31.5700 -13.2300
73 C1b C 16.4500 -19.5300
74 C1c C 15.1900 -20.2300
75 C1b C 13.7900 -19.5300
76 O2b O 11.8300 -20.2300
77 O1a O 15.1900 -21.6300
78 P1b P 10.4300 -20.2300
79 O1c O 10.4300 -18.8300
80 O1c O 10.4300 -21.6300
81 O2b O 9.0300 -20.2300
82 C1b C 7.8400 -19.5300
83 C1c C 6.5800 -20.2300
84 C1c C 5.3900 -19.5300
85 C1c C 4.2000 -20.2300
86 C1b C 2.9400 -19.5300
87 O2a O 6.5800 -21.6300
88 O1a O 5.3900 -18.1300
89 O1a O 4.2000 -21.6300
90 O1a O 1.7500 -20.2300
91 C1y C 6.5800 -23.0300
92 O2x O 5.3900 -23.7300
93 C1y C 5.3900 -25.1300
94 C1y C 6.5800 -25.8300
95 C1y C 7.8400 -25.1300
96 C1y C 7.8400 -23.7300
97 N1b N 9.0300 -23.0300
98 C5a C 10.2900 -23.7300
99 O5a O 11.4800 -23.0300
100 C1a C 10.2900 -25.1300
101 O1a O 9.0300 -25.8300
102 O1a O 6.5800 -27.2300
103 C1b C 4.2000 -25.8300
104 O1a O 4.2000 -27.2300
BOND 108
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 1 #Up
8 9 4 1 #Up
9 5 10 1
10 5 11 1 #Down
11 6 12 1
12 9 13 1
13 9 14 1
14 10 15 1 #Down
15 12 16 1
16 12 17 1 #Down
17 13 18 1
18 13 19 1 #Down
19 14 20 1
20 15 21 1
21 16 22 2
22 18 23 1
23 18 24 1 #Up
24 19 25 1
25 20 26 1 #Up
26 23 27 1 #Down
27 25 28 1
28 25 29 2
29 27 30 1
30 7 10 1
31 20 23 1
32 11 31 1
33 31 32 2
34 31 33 1
35 16 34 1
36 34 35 1
37 35 36 1
38 35 37 1
39 26 38 1
40 8 39 1
41 40 37 1 #Down
42 40 41 1
43 41 42 1
44 42 43 1
45 43 44 1
46 44 45 1
47 40 45 1
48 45 46 1 #Down
49 46 47 1
50 47 48 2
51 47 49 1
52 44 50 1 #Up
53 43 51 1 #Down
54 42 52 1 #Up
55 52 53 1
56 54 51 1 #Up
57 54 55 1
58 55 56 1
59 56 57 1
60 57 58 1
61 58 59 1
62 54 59 1
63 59 60 1 #Up
64 58 61 1 #Up
65 57 62 1 #Down
66 56 63 1 #Up
67 60 64 1
68 64 65 2
69 64 66 1
70 63 67 1
71 62 68 1
72 68 69 1
73 68 70 2
74 68 71 1
75 35 72 2
76 71 73 1
77 73 74 1
78 74 75 1
79 75 76 1
80 74 77 1 #Down
81 76 78 1
82 78 79 2
83 78 80 1
84 78 81 1
85 81 82 1
86 82 83 1
87 83 84 1
88 84 85 1
89 85 86 1
90 83 87 1 #Up
91 84 88 1 #Down
92 85 89 1 #Up
93 86 90 1
94 91 87 1 #Either
95 91 92 1
96 92 93 1
97 93 94 1
98 94 95 1
99 95 96 1
100 91 96 1
101 96 97 1 #Down
102 97 98 1
103 98 99 2
104 98 100 1
105 95 101 1 #Up
106 94 102 1 #Down
107 93 103 1 #Up
108 103 104 1
BRACKET 1 38.7100 -6.1600 40.6000 -6.1600
1 40.7400 -19.5300 38.7800 -19.5300
1 l
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16
1 17 18 19 20 22 23 24 25 26 27 28 29 31 32 33 34
1 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50
1 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66
1 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82
1 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98
1 99 100 101 102 103 104
REPEAT 1
2 14.0000 -21.0000 14.0000 -18.9000
2 20.9300 -18.9700 20.9300 -21.0700
2 m
ORIGINAL 2 62 68 69 70 71 73 74 77
REPEAT 2
3 2.8000 -20.9300 2.8000 -18.8300
3 12.3200 -18.9000 12.3200 -21.0000
3 n
ORIGINAL 3 76 78 79 80 81 82 83 84 85 86 87 88 89 91 92 93
3 94 95 96 97 98 99 100 101 102 103 104
REPEAT 3
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